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Compound Detail

CHEMBL1385327

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COC(CN(C(=O)CCl)C(C(=O)NC1CCCCC1)c1ccccc1C)OC

Basic Information

ChEMBL ID CHEMBL1385327
Phase Preclinical
Structure Type MOL
InChI Key SZASELIGDZEEFS-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

410.9
MW (Da)
3.17
ALogP
4
HBA
1
HBD
67.9
PSA (Ų)
0.50
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H31ClN2O4
MW 410.94
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness -1.20

Activity Summary

IC50 3 meas. best 5.42

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Nuclear receptor coactivator 3
CHEMBL1615382
IC50 5.42 5.42 3755.0 1
Tegument protein VP16
CHEMBL4218
IC50 5.07 5.07 8466.0 1
Nuclear receptor coactivator 1
CHEMBL1615387
IC50 5.02 5.02 9531.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine